| CAS Number | 13816-02-9 |
| Catalog Number | AG00HV8C(AGN-PC-00NJUP) |
| Chemical Name | 2-Ethenyl-1,3-thiazole |
| IUPAC Name | 2-ethenyl-1,3-thiazole |
| InChI | InChI=1S/C5H5NS/c1-2-5-6-3-4-7-5/h2-4H,1H2 |
| InChI Key | JDCUKFVNOWJNBU-UHFFFAOYSA-N |
| MDL Number | MFCD12911553 |
| Molecular Formula | C5H5NS |
| Molecular Weight | 111.1649 |
| SMILES | C=CC1SC=CN=1 |
| Synonyms | 2-vinylthiazole,
13816-02-9,
2-ethenyl-1,3-thiazole,
Thiazole, 2-ethenyl-,
vinylthiazole,
2-vinyl-1,3-thiazole,
SCHEMBL39666,
JDCUKFVNOWJNBU-UHFFFAOYSA-N,
KS-00000TJ7,
MFCD12911553,
ZINC34122631,
AKOS017517987,
AK251551,
DS-10643,
|
| Complexity | 72.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 111.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 111.162g/mol |
| Monoisotopic Mass | 111.014g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number